SCHEMBL5584563

SCHEMBL5584563

C=CC1CC1(Br)Br

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7193203 0.75
SCHEMBL9861244 0.69
SCHEMBL10777843 0.68
SCHEMBL10819074 0.67
SCHEMBL24838825 0.67
SCHEMBL10353184 0.67
SCHEMBL1412724 0.67
SCHEMBL3995563 0.67
SCHEMBL10778658 0.64
SCHEMBL1101946 0.63

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025124459-A1 TRICYCLIC FUSED HETEROCYCLIC PDE3/4 DUAL INHIBITOR, AND PREPARATION AND USE THEREFOR 石家庄以岭药业股份有限公司 2025-06-19 WO disclosed
CN-120136868-A Tricyclic fused heterocyclic PDE3/4 dual inhibitor and preparation method and application thereof 石家庄以岭药业股份有限公司 2025-06-13 CN disclosed
US-20200181192-A1 DISULFIDE BIOCONJUGATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-06-11 US disclosed
US-7164047-B2 Subjecting a 3-cyclopropyl-2,3-epoxypropionic acid ester to solvolysis in the presence of a base, treating the product of the solvolysis with an acid to obtain cyclopropylacetaldehyde, and reducing the obtained cyclopropylacetaldehyde; low cost, industrially advantageous KURARAY CO., LTD. (JP) 2007-01-16 US disclosed
US-20050020846-A1 Subjecting a 3-cyclopropyl-2,3-epoxypropionic acid ester to solvolysis in the presence of a base, treating the product of the solvolysis with an acid to obtain cyclopropylacetaldehyde, and reducing the obtained cyclopropylacetaldehyde; low cost, industrially advantageous KURARAY CO., LTD. (JP) 2005-01-27 US disclosed
EP-1445248-A1 PROCESSES FOR PREPARATION OF CYCLOPROPYLETHANOL, CYCLO-PROPYLACETONITRILE AND INTERMEDIATES OF BOTH KURARAY CO., LTD. (JP) 2004-08-11 EP disclosed
US-4714714-A Arachidonic acid analogs E. R. SQUIBB & SONS, INC. (US) 1987-12-22 US disclosed
US-4599439-A Arachidonic acid analogs E. R. SQUIBB & SONS, INC. (US) 1986-07-08 US disclosed
US-3954730-A ANTIBIOTICS BAYER AKTIENGESELLSCHAFT (DT) 1976-05-04 US disclosed